Home Other Building Blocks 2,4,5-Trifluorothioanisole

2,4,5-Trifluorothioanisole

CAS No.:
54378-74-4
Catalog Number:
AG003FLY
Molecular Formula:
C7H5F3S
Molecular Weight:
178.1748
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
98%
In Stock USA
United States
$75
- +
250mg
98%
In Stock USA
United States
$150
- +
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG003FLY
Chemical Name:
2,4,5-Trifluorothioanisole
CAS Number:
54378-74-4
Molecular Formula:
C7H5F3S
Molecular Weight:
178.1748
MDL Number:
MFCD12026061
IUPAC Name:
1,2,4-trifluoro-5-methylsulfanylbenzene
InChI:
InChI=1S/C7H5F3S/c1-11-7-3-5(9)4(8)2-6(7)10/h2-3H,1H3
InChI Key:
XHRKZFKNYGRFIQ-UHFFFAOYSA-N
SMILES:
CSc1cc(F)c(cc1F)F
Properties
Complexity:
131  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
178.006g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
178.172g/mol
Monoisotopic Mass:
178.006g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
25.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties